N-[(Z)-3-(3-hydroxyanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide

Formula:C22H17N3O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-3-(3-hydroxyanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(Z)-3-(3-hydroxyanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C22H17N3O5
Smiles	[O-][N+](c1ccc(/C=C(/C(Nc2cc(O)ccc2)=O)\NC(c2ccccc2)=O)cc1)=O
InChI	InChI=1S/C22H17N3O5/c26-19-8-4-7-17(14-19)23-22(28)20(24-21(27)16-5-2-1-3-6-16)13-15-9-11-18(12-10-15)25(29)30/h1-14,26H,(H,23,28)(H,24,27)
InChIK	CHQNUFOZQNGWKH-UHFFFAOYSA-N
TotalMolweight	403.393
Molweight	403.393
MonoisotopicMass	403.116822
CLogP	3.1565
CLogS	-5.037
H Acceptors	8
H Donors	3
TotalSurfaceArea	305.93
Relative PSA	0.30242
PolarSurfaceArea	124.25
Druglikeness	-2.1049
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.46667
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	4
Amides	2
AcidicOxygens	1
StereoCon

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